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BDBM50020563 CHEMBL151619::N-Benzyl-3-{3-[2-tert-butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-5-methyl-hexanoylamino}-succinamic acid

SMILES: CC(C)C[C@@H](CC(=O)NC(CC(O)=O)C(=O)NCc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C

InChI Key: InChIKey=MTZRAOFVZUYMGX-LSSUXWNUSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50020563   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cholecystokinin receptor


(Homo sapiens (Human))		BDBM50020563
PNG
(CHEMBL151619 | N-Benzyl-3-{3-[2-tert-butoxycarbony...)
Show SMILES CC(C)C[C@@H](CC(=O)NC(CC(O)=O)C(=O)NCc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C
Show InChI InChI=1S/C34H45N5O7/c1-21(2)15-24(17-29(40)38-28(18-30(41)42)31(43)36-19-22-11-7-6-8-12-22)37-32(44)27(39-33(45)46-34(3,4)5)16-23-20-35-26-14-10-9-13-25(23)26/h6-14,20-21,24,27-28,35H,15-19H2,1-5H3,(H,36,43)(H,37,44)(H,38,40)(H,39,45)(H,41,42)/t24-,27+,28?/m0/s1
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PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



INSERM

Curated by ChEMBL


Assay Description
Invitro inhibition of binding of [125I]-(Nle)-HG-13 labeled Cholecystokinin type B receptor on isolated gastric mucosal cells of rabbit

J Med Chem 32: 522-8 (1989)


BindingDB Entry DOI: 10.7270/Q2MW2G4H
More data for this
Ligand-Target Pair